Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jct_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N THR 9.A O no hydrogen 2.875 N/A ASP 5.A N ILE 2.A O no hydrogen 3.320 N/A GLU 6.A N CYS 51.A O no hydrogen 3.250 N/A ARG 8.A N GLN 52.A OE1 no hydrogen 2.735 N/A ARG 8.A NE ASP 5.A OD1 no hydrogen 3.254 N/A ARG 8.A NH1 ASP 5.A OD1 no hydrogen 3.426 N/A ARG 8.A NH1 GLY 55.A O no hydrogen 2.547 N/A ARG 8.A NH2 GLY 55.A O no hydrogen 3.244 N/A THR 9.A N ASP 5.A O no hydrogen 2.406 N/A THR 9.A OG1 ASP 5.A O no hydrogen 2.397 N/A CYS 12.A SG LYS 89.A O no hydrogen 3.555 N/A ILE 15.A N GLN 48.A O no hydrogen 2.782 N/A THR 16.A N LYS 94.A O no hydrogen 3.063 N/A THR 16.A OG1 THR 93.A OG1 no hydrogen 2.715 N/A PHE 17.A N ALA 50.A O no hydrogen 2.914 N/A ILE 18.A N VAL 96.A O no hydrogen 2.727 N/A PHE 19.A N GLN 52.A O no hydrogen 3.028 N/A ALA 20.A N GLY 98.A O no hydrogen 3.209 N/A ARG 21.A NE GLU 25.A O no hydrogen 2.981 N/A ARG 21.A NH1 TYR 58.A O no hydrogen 3.199 N/A ARG 21.A NH2 TYR 58.A O no hydrogen 2.683 N/A GLY 22.A N GLU 25.A OE1 no hydrogen 2.990 N/A THR 24.A N ALA 60.A O no hydrogen 2.552 N/A THR 24.A OG1 SER 23.A O no hydrogen 2.305 N/A GLU 25.A N GLY 22.A O no hydrogen 3.250 N/A ILE 31.A N GLU 25.A OE2 no hydrogen 3.365 N/A THR 32.A OG1 GLU 25.A OE1 no hydrogen 3.004 N/A THR 32.A OG1 GLU 25.A OE2 no hydrogen 2.534 N/A VAL 37.A N THR 33.A O no hydrogen 2.708 N/A CYS 38.A N GLY 34.A O no hydrogen 2.649 N/A ASN 39.A N PRO 35.A O no hydrogen 3.045 N/A ALA 40.A N GLY 36.A O no hydrogen 2.772 N/A LEU 41.A N VAL 37.A O no hydrogen 2.900 N/A LEU 41.A N CYS 38.A O no hydrogen 2.784 N/A LYS 42.A N CYS 38.A O no hydrogen 3.070 N/A LYS 42.A NZ GLU 6.A OE2 no hydrogen 2.722 N/A LYS 42.A NZ VAL 49.A O no hydrogen 3.146 N/A LEU 43.A N ASN 39.A O no hydrogen 2.880 N/A SER 44.A N ALA 40.A O no hydrogen 3.179 N/A SER 44.A OG ALA 40.A O no hydrogen 2.716 N/A ARG 45.A N LEU 41.A O no hydrogen 3.002 N/A ARG 45.A NH1 VAL 187.A O no hydrogen 2.539 N/A ARG 45.A NH2 VAL 187.A O no hydrogen 2.982 N/A ALA 50.A N ILE 15.A O no hydrogen 2.904 N/A GLN 52.A N PHE 17.A O no hydrogen 2.780 N/A GLN 52.A NE2 ASP 5.A OD1 no hydrogen 3.292 N/A GLN 52.A NE2 GLY 53.A O no hydrogen 2.865 N/A GLY 53.A N GLY 4.A O no hydrogen 2.592 N/A ALA 57.A N GLU 78.A OE2 no hydrogen 3.370 N/A TYR 58.A N GLU 78.A OE1 no hydrogen 2.759 N/A TYR 58.A OH ARG 21.A O no hydrogen 2.590 N/A THR 59.A OG1 ASP 61.A OD1 no hydrogen 2.912 N/A SER 64.A OG ASP 61.A OD1 no hydrogen 2.764 N/A SER 64.A OG ASP 61.A OD2 no hydrogen 3.498 N/A ASN 65.A N LEU 62.A O no hydrogen 2.843 N/A ASN 65.A ND2 SER 23.A OG no hydrogen 3.113 N/A ASN 65.A ND2 LEU 62.A O no hydrogen 2.621 N/A PHE 66.A N ALA 63.A O no hydrogen 3.303 N/A LEU 67.A N SER 64.A O no hydrogen 3.267 N/A GLY 70.A N LEU 67.A O no hydrogen 2.697 N/A THR 71.A OG1 GLN 102.A OE1 no hydrogen 2.856 N/A ALA 75.A N SER 72.A OG no hydrogen 2.960 N/A ILE 76.A N SER 72.A O no hydrogen 3.094 N/A ASP 77.A N GLN 73.A O no hydrogen 2.624 N/A GLU 78.A N ILE 74.A O no hydrogen 2.753 N/A ALA 79.A N ALA 75.A O no hydrogen 3.033 N/A ALA 80.A N ILE 76.A O no hydrogen 2.725 N/A GLY 81.A N ASP 77.A O no hydrogen 2.946 N/A LEU 82.A N GLU 78.A O no hydrogen 3.189 N/A PHE 83.A N ALA 79.A O no hydrogen 3.085 N/A LYS 84.A N ALA 80.A O no hydrogen 3.111 N/A LEU 85.A N GLY 81.A O no hydrogen 2.715 N/A ALA 86.A N LEU 82.A O no hydrogen 2.963 N/A ALA 87.A N PHE 83.A O no hydrogen 3.096 N/A SER 88.A N LYS 84.A O no hydrogen 2.749 N/A SER 88.A OG LYS 84.A O no hydrogen 3.146 N/A LYS 89.A N LEU 85.A O no hydrogen 2.700 N/A LYS 89.A NZ LEU 7.A O no hydrogen 2.655 N/A LYS 89.A NZ GLY 10.A O no hydrogen 2.706 N/A CYS 90.A N ALA 86.A O no hydrogen 2.727 N/A THR 93.A N CYS 90.A O no hydrogen 3.156 N/A THR 93.A OG1 GLU 13.A O no hydrogen 2.784 N/A THR 93.A OG1 THR 16.A OG1 no hydrogen 2.715 N/A LYS 94.A N PRO 14.A O no hydrogen 3.004 N/A LYS 94.A NZ LEU 188.A O no hydrogen 2.959 N/A ILE 95.A N MET 121.A O no hydrogen 2.772 N/A VAL 96.A N THR 16.A O no hydrogen 2.888 N/A ALA 97.A N GLY 124.A O no hydrogen 2.983 N/A GLY 98.A N ILE 18.A O no hydrogen 2.793 N/A TYR 100.A N ALA 20.A O no hydrogen 3.214 N/A TYR 100.A OH HIS 169.A O no hydrogen 3.323 N/A SER 101.A N PHE 128.A O no hydrogen 3.132 N/A SER 101.A OG HIS 169.A NE2 no hydrogen 2.702 N/A GLN 102.A NE2 SER 23.A OG no hydrogen 2.945 N/A GLN 102.A NE2 ASP 61.A O no hydrogen 2.907 N/A GLY 103.A N TYR 100.A O no hydrogen 2.791 N/A ALA 104.A N SER 101.A O no hydrogen 2.869 N/A ALA 105.A N SER 101.A O no hydrogen 3.430 N/A VAL 106.A N GLN 102.A O no hydrogen 2.885 N/A MET 107.A N GLY 103.A O no hydrogen 3.202 N/A HIS 108.A N ALA 104.A O no hydrogen 2.699 N/A HIS 108.A ND1 ASP 136.A OD2 no hydrogen 2.554 N/A HIS 108.A NE2 ASP 130.A OD2 no hydrogen 2.495 N/A GLY 109.A N ALA 105.A O no hydrogen 2.989 N/A GLY 109.A N VAL 106.A O no hydrogen 3.126 N/A ALA 110.A N VAL 106.A O no hydrogen 2.816 N/A ILE 111.A N MET 107.A O no hydrogen 2.825 N/A VAL 118.A N PRO 115.A O no hydrogen 3.145 N/A GLN 119.A N PRO 115.A O no hydrogen 2.977 N/A GLN 119.A NE2 ILE 111.A O no hydrogen 2.979 N/A GLN 119.A NE2 ASN 142.A O no hydrogen 2.870 N/A ASN 120.A N SER 116.A O no hydrogen 2.990 N/A MET 121.A N VAL 118.A O no hydrogen 3.002 N/A ILE 122.A N GLN 119.A O no hydrogen 3.074 N/A LYS 123.A N ILE 95.A O no hydrogen 2.832 N/A LYS 123.A NZ ASN 120.A O no hydrogen 2.700 N/A VAL 125.A N ARG 147.A O no hydrogen 2.793 N/A VAL 126.A N ALA 97.A O no hydrogen 3.118 N/A LEU 127.A N LYS 149.A O no hydrogen 2.912 N/A PHE 128.A N GLY 99.A O no hydrogen 2.840 N/A GLY 129.A N TYR 151.A O no hydrogen 2.913 N/A ARG 132.A N ASP 130.A OD1 no hydrogen 2.843 N/A ARG 132.A NH1 PRO 68.A O no hydrogen 3.005 N/A ARG 132.A NH2 PRO 68.A O no hydrogen 3.328 N/A ASN 133.A ND2 CYS 159.A O no hydrogen 2.688 N/A LYS 134.A N GLN 135.A OE1 no hydrogen 3.256 N/A LYS 134.A NZ ASP 160.A O no hydrogen 3.259 N/A GLN 135.A N GLN 135.A OE1 no hydrogen 2.578 N/A GLN 135.A NE2 THR 131.A O no hydrogen 2.822 N/A ASP 136.A N ARG 132.A O no hydrogen 3.087 N/A GLY 138.A N ASN 133.A O no hydrogen 2.595 N/A ASN 142.A ND2 ARG 112.A O no hydrogen 3.259 N/A PHE 143.A N ILE 140.A O no hydrogen 3.213 N/A ARG 147.A NH1 GLN 119.A O no hydrogen 3.121 N/A ARG 147.A NH1 ILE 122.A O no hydrogen 3.000 N/A THR 148.A N THR 145.A O no hydrogen 3.297 N/A THR 148.A OG1 PRO 144.A O no hydrogen 3.479 N/A LYS 149.A N VAL 125.A O no hydrogen 3.030 N/A TYR 151.A N LEU 127.A O no hydrogen 2.621 N/A ALA 153.A N TYR 172.A OH no hydrogen 2.693 N/A ASP 156.A N ALA 153.A O no hydrogen 3.020 N/A VAL 158.A N ASP 156.A OD1 no hydrogen 3.303 N/A CYS 159.A N ASP 156.A O no hydrogen 3.351 N/A CYS 159.A SG ASP 130.A O no hydrogen 3.922 N/A ASP 160.A N LEU 157.A O no hydrogen 3.105 N/A THR 162.A OG1 LEU 157.A O no hydrogen 2.793 N/A ALA 168.A N THR 166.A OG1 no hydrogen 3.007 N/A HIS 169.A N THR 166.A O no hydrogen 3.117 N/A HIS 169.A N THR 166.A OG1 no hydrogen 3.205 N/A HIS 169.A ND1 ASP 156.A OD2 no hydrogen 3.246 N/A LEU 170.A N ALA 167.A O no hydrogen 3.359 N/A SER 171.A OG ALA 168.A O no hydrogen 2.774 N/A TYR 172.A OH ASP 156.A OD2 no hydrogen 2.483 N/A ASP 174.A N SER 171.A O no hydrogen 3.034 N/A ASP 175.A N TYR 172.A O no hydrogen 3.110 N/A VAL 176.A N GLY 173.A O no hydrogen 3.380 N/A ALA 179.A N ASP 175.A O no hydrogen 2.753 N/A THR 180.A N VAL 176.A O no hydrogen 2.752 N/A THR 180.A OG1 VAL 176.A O no hydrogen 2.220 N/A SER 181.A N PRO 177.A O no hydrogen 3.174 N/A SER 181.A OG PRO 177.A O no hydrogen 3.446 N/A PHE 182.A N ASN 178.A O no hydrogen 2.945 N/A LEU 183.A N ALA 179.A O no hydrogen 2.920 N/A LEU 184.A N THR 180.A O no hydrogen 2.802 N/A SER 185.A N SER 181.A O no hydrogen 2.656 N/A SER 185.A OG PHE 182.A O no hydrogen 2.518 N/A LYS 186.A N PHE 182.A O no hydrogen 3.465 N/A LYS 186.A NZ ASP 146.A OD2 no hydrogen 3.162 N/A VAL 187.A N LEU 183.A O no hydrogen 3.203 N/A